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Dyrk1A-IN-3

CAT: 0931-T60824-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T60824-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2493976-27-3
Target
DYRK, Others
Related Pathways
Others, Tyrosine Kinase/Adaptors, Cell Cycle/Checkpoint
Bioactivity
Dyrk1A-IN-3 (Compound 8b) is a highly selective inhibitor of dual-specificity tyrosine-regulated kinase 1A (DYRK1A) with a high binding affinity (IC50 of 76 nM) . Dyrk1A-IN-3 can be used in neurodegenerative disorders research, such as Alzheimer's Disease, Huntington's Disease, and Parkinson's Disease [1].
Smiles
N(C)(C=1N=C(C2=C3N(N=C2)N=CC=C3)C=CN1)C4=CC(C)=CC=C4
Molecular Formula
C18H16N6
Molecular Weight
316.36
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Dyrk1A-IN-3
CAS Number2493976-27-3
PubChem CID156011155
IUPAC NameN-methyl-N-(3-methylphenyl)-4-pyrazolo[1,5-b]pyridazin-3-ylpyrimidin-2-amine
Molecular FormulaC18H16N6
Molecular Weight316.4
XLogP3
Topological Polar Surface Area59.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count24
Formal Charge0
Complexity418
SMILES
CC1=CC(=CC=C1)N(C)C2=NC=CC(=N2)C3=C4C=CC=NN4N=C3
InChI
InChI=1S/C18H16N6/c1-13-5-3-6-14(11-13)23(2)18-19-10-8-16(22-18)15-12-21-24-17(15)7-4-9-20-24/h3-12H,1-2H3
InChIKey
XOBINHQHMGZFDI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dyrk1A-IN-3
CAS: 2493976-27-3
CID: 156011155
Formula: C18H16N6
MW: 316.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight316.4
XLogP33
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass316.14364454
Monoisotopic Mass316.14364454
Topological Polar Surface Area59.2 Ų
Heavy Atom Count24
Formal Charge0
Complexity418
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
BA8912-1Dyrk1A-IN-3
pka-310DYRK1A
BZ66669PCMV6-DYRK1A-3*FLAG
BA8910-5Dyrk1A-IN-5
BA8911-1Dyrk1A-IN-4
70R-8634Dyrk1a antibody
HY-139830Dyrk1A-IN-1
HY-162597Dyrk1A-IN-9
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